N-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride

C16H23ClF3N3O2 — CID 119824854

IUPACN-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride
SMILESCCCN(C(=O)c1ccc(OCC(F)(F)F)nc1)C1CCNCC1.Cl
InChIInChI=1S/C16H22F3N3O2.ClH/c1-2-9-22(13-5-7-20-8-6-13)15(23)12-3-4-14(21-10-12)24-11-16(17,18)19;/h3-4,10,13,20H,2,5-9,11H2,1H3;1H
InChIKeyLWWAIWQROHBGPN-UHFFFAOYSA-N
MW381.83 g/mol
LogP3.05
Rot. Bonds6

About N-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride

N-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride (PubChem CID 119824854) has the molecular formula C16H23ClF3N3O2 and a molecular weight of 381.83 g/mol. Its IUPAC name is N-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride
PubChem CID119824854
Molecular FormulaC16H23ClF3N3O2
Molecular Weight381.83 g/mol
Exact Mass381.14
IUPAC NameN-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride
SMILESCCCN(C(=O)c1ccc(OCC(F)(F)F)nc1)C1CCNCC1.Cl
InChIInChI=1S/C16H22F3N3O2.ClH/c1-2-9-22(13-5-7-20-8-6-13)15(23)12-3-4-14(21-10-12)24-11-16(17,18)19;/h3-4,10,13,20H,2,5-9,11H2,1H3;1H
InChIKeyLWWAIWQROHBGPN-UHFFFAOYSA-N
XLogP3.05
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.83
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-piperidin-4-yl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 119388337
4-ethyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119823008
4-iodo-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119822992
N-piperidin-4-yl-3,4-dipropoxy-N-propylbenzamide
CID 119825767
N-piperidin-4-yl-N-propylpyridine-4-carboxamide
CID 54923494
3-methoxy-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119823113
6-imidazol-1-yl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide
CID 119825756
4-pentoxy-N-piperidin-4-yl-N-propylbenzamide
CID 119825577
N-cyclopropyl-N-(thiophen-2-ylmethyl)-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 134004580
N-cyclopropyl-N-(2-hydroxyethyl)-6-methoxypyridine-3-carboxamide
CID 43577386
N-propyl-N-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide
CID 115737122
4-cyclohexyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119823082

Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride?
The IUPAC name of N-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride (CID 119824854) is N-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride?
The canonical SMILES for N-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride is CCCN(C(=O)c1ccc(OCC(F)(F)F)nc1)C1CCNCC1.Cl.
What is the InChIKey of N-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride?
The InChIKey is LWWAIWQROHBGPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22F3N3O2.ClH/c1-2-9-22(13-5-7-20-8-6-13)15(23)12-3-4-14(21-10-12)24-11-16(17,18)19;/h3-4,10,13,20H,2,5-9,11H2,1H3;1H.
What are the key properties of N-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride?
N-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride has a molecular weight of 381.83 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-yl-N-propyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119824854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).